N-butan-2-yl-2-(4-fluorophenyl)sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-butan-2-yl-2-(4-fluorophenyl)sulfanyl-quinoline-4-carboxamide Openeye Name: 2-(4-fluorophenyl)sulfanyl-N-sec-butyl-quinoline-4-carboxamide CAS Name: N-butan-2-yl-2-[(4-fluorophenyl)thio]-4-quinolinecarboxamide IUPAC Name: N-butan-2-yl-2-(4-fluorophenyl)sulfanylquinoline-4-carboxamide Traditional Name: 2-[(4-fluorophenyl)thio]-N-sec-butyl-cinchoninamide Formula: C20H19FN2OS MolecularWeight: 354.441063

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC(=NC2=CC=CC=C21)SC3=CC=C(C=C3)F

Isomeric SMILES

CCC(C)NC(=O)C1=CC(=NC2=CC=CC=C21)SC3=CC=C(C=C3)F

InChI

InChI=1S/C20H19FN2OS/c1-3-13(2)22-20(24)17-12-19(23-18-7-5-4-6-16(17)18)25-15-10-8-14(21)9-11-15/h4-13H,3H2,1-2H3,(H,22,24)